SCHEMBL301845

SCHEMBL301845

NCc1cccc(C2CCN(C(=O)c3ccc(C#Cc4ccccc4F)o3)CC2)c1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.67
PRSS1 P07477 6/20 0.61
PRSS2 P07478 6/20 0.61
PRSS3 P35030 6/20 0.61
TPSAB1 Q15661 8/20 0.49
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Trifluoroacetic Acid SCHEMBL6804030 0.95 F10 (0.76) F10PRSS1PRSS2PRSS3TPSAB1
SCHEMBL972001 0.95 F10 (0.62) F10PRSS1PRSS2PRSS3TPSAB1
SCHEMBL4408248 0.87 F10 (0.71) F10PRSS1PRSS2PRSS3TPSAB1
Trifluoroacetic Acid SCHEMBL1381804 0.84 F10 (0.80) F10PRSS1PRSS2PRSS3TPSAB1
SCHEMBL15788530 0.84 F10 (0.51) F10PRSS1PRSS2PRSS3TPSAB1
SCHEMBL6807311 0.84 F10 (0.49) F10PRSS1PRSS2PRSS3TPSAB1
SCHEMBL6808390 0.84 F10 (0.55) F10PRSS1PRSS2PRSS3TPSAB1
SCHEMBL18652788 0.83 F10 (0.49) F10PRSS1PRSS2PRSS3TPSAB1
SCHEMBL302010 0.83 F10 (0.51) F10PRSS1PRSS2PRSS3TPSAB1
SCHEMBL15788529 0.83 F10 (0.50) F10PRSS1PRSS2PRSS3TPSAB1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4851440-B2 2012-01-11 JP claimed
EP-1723140-B1 PROCESS FOR THE PREPARATION OF TRYPTASE INHIBITORS AVENTIS PHARMA INC (US) 2009-11-04 EP claimed
US-20070197597-A1 Process for the preparation of tryptase inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-08-23 US claimed
EP-1723140-A1 PROCESS FOR THE PREPARATION OF TRYPTASE INHIBITORS Aventis Pharmaceuticals Inc. (US) 2006-11-22 EP claimed
WO-2005095385-A1 PROCESS FOR THE PREPARATION OF TRYPTASE INHIBITORS AVENTIS PHARMACEUTICALS INC. (US) 2005-10-13 WO claimed
EP-1571150-A1 Process for the preparation of tryptase inhibitors Aventis Pharma Deutschland GmbH (DE) 2005-09-07 EP claimed
EP-4665322-A1 DYSREGULATION OF PLANKTONIC BACTERIAL METABOLISM Neolixir Limited (AU) 2025-12-24 EP disclosed
US-20240397944-A1 METHODS FOR BIOFILM DISRUPTION Lixa Limited (AU) 2024-12-05 US disclosed
WO-2024229525-A1 DYSREGULATION OF PLANKTONIC BACTERIAL METABOLISM Neolixir Limited (AU) 2024-11-14 WO disclosed
EP-4429651-A1 METHODS FOR BIOFILM DISRUPTION Neolixir Limited (AU) 2024-09-18 EP disclosed
CN-118251216-A Method for biofilm disruption 尼尔利希尔有限公司 2024-06-25 CN disclosed
CN-112279772-B Alpha, alpha-dideuteronamine compound, deuterated medicament and preparation method thereof 北京奇点势能科技有限公司 2023-06-30 CN disclosed
WO-2023081974-A1 METHODS FOR BIOFILM DISRUPTION Neolixir Pty Ltd (AU) 2023-05-19 WO disclosed
US-20070197597-A1 Process for the preparation of tryptase inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-08-23 US disclosed
EP-1723140-A1 PROCESS FOR THE PREPARATION OF TRYPTASE INHIBITORS Aventis Pharmaceuticals Inc. (US) 2006-11-22 EP disclosed
WO-2005095385-A1 PROCESS FOR THE PREPARATION OF TRYPTASE INHIBITORS AVENTIS PHARMACEUTICALS INC. (US) 2005-10-13 WO disclosed
WO-2005095385-A1 PROCESS FOR THE PREPARATION OF TRYPTASE INHIBITORS AVENTIS PHARMACEUTICALS INC. (US) 2005-10-13 WO disclosed
EP-1571150-A1 Process for the preparation of tryptase inhibitors Aventis Pharma Deutschland GmbH (DE) 2005-09-07 EP disclosed
WO-2004060884-A1 [4-(3-AMINOMETHYLPHENYL) PIPERIDIN-1-YL]- [5-(2-FLUOROPHENYLETHYNYL)FURAN-2-YL]-METHANONE AS AN INHIBITOR OF MAST CELL TRYPTASE AVENTIS PHARMACEUTICALS INC. (US) 2004-07-22 WO disclosed
WO-2004060884-A1 [4-(3-AMINOMETHYLPHENYL) PIPERIDIN-1-YL]- [5-(2-FLUOROPHENYLETHYNYL)FURAN-2-YL]-METHANONE AS AN INHIBITOR OF MAST CELL TRYPTASE AVENTIS PHARMACEUTICALS INC. (US) 2004-07-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240397944-A1 METHODS FOR BIOFILM DISRUPTION FGB, MMP8, HAO2 F10 471/4885PRSS1 1004/4885PRSS2 503/4885
US-20070197597-A1 Process for the preparation of tryptase inhibitors CMA1, TPSAB1, TPSB2 F10 224/4885PRSS1 20/4885PRSS2 28/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.